In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 19 | No |
Popular Name: N-(3-amino-3-thioxo-propyl)-2,2-dimethyl-N-(3-pyridylmethyl)propanamide N-(3-amino-3-thioxo-propyl)-2,2-…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.71 | 5.02 | -15.44 | 2 | 4 | 0 | 59 | 279.409 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.71 | 5.47 | -44.39 | 3 | 4 | 1 | 60 | 280.417 | 6 | ↓ |